1-morpholin-4-yl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-2-phenyl-ethanone

Systemtic Name: 1-morpholin-4-yl-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-2-phenyl-ethanone Openeye Name: 1-morpholino-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-2-phenyl-ethanone CAS Name: 1-(4-morpholinyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]-2-phenylethanone IUPAC Name: 1-morpholin-4-yl-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-2-phenylethanone Traditional Name: 1-morpholino-2-[(1-oxidopyridin-1-ium-2-yl)thio]-2-phenyl-ethanone Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1COCCN1C(=O)C(C2=CC=CC=C2)SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H18N2O3S/c20-17(18-10-12-22-13-11-18)16(14-6-2-1-3-7-14)23-15-8-4-5-9-19(15)21/h1-9,16H,10-13H2